SCHEMBL22650230

SCHEMBL22650230

Clc1nc(-c2ccccc2)nc(-c2cccnc2)n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.54
ALDH1A1 P00352 9/20 0.53
SMN1; SMN2 Q16637 6/20 0.53
MAPT P10636 5/20 0.53
TP53 P04637 4/20 0.53
HPGD P15428 4/20 0.53
KDM4E B2RXH2 3/20 0.53
LMNA P02545 3/20 0.53
HSD17B10 Q99714 3/20 0.53
ALOX15 P16050 1/20 0.53
HTT P42858 1/20 0.53
CYP1A2 P05177 4/20 0.53
CYP3A4 P08684 4/20 0.53
CLK4 Q9HAZ1 3/20 0.53
TSHR P16473 3/20 0.53
CYP2D6 P10635 2/20 0.53
CYP2C9 P11712 2/20 0.53
MEN1 O00255 1/20 0.53
GLA P06280 1/20 0.53
CYP2A6 P11509 3/20 0.52

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL17486128 0.94 ALDH1A1 (0.59) KMT2AALDH1A1SMN1; SMN2MAPTTP53
SCHEMBL20465274 0.93 MKNK1 (0.53) KMT2AALDH1A1SMN1; SMN2MAPTTP53
SCHEMBL17050896 0.90 ALDH1A1 (0.59) KMT2AALDH1A1SMN1; SMN2MAPTTP53
SCHEMBL5590272 0.90 ALDH1A1 (0.64) KMT2AALDH1A1SMN1; SMN2MAPTTP53
SCHEMBL5590400 0.90 ALDH1A1 (0.64) KMT2AALDH1A1SMN1; SMN2MAPTTP53
SCHEMBL21707244 0.89 CYP2A6 (0.56) ALDH1A1SMN1; SMN2MAPTTP53HPGD
SCHEMBL9920519 0.88 ALDH1A1 (0.61) KMT2AALDH1A1SMN1; SMN2MAPTTP53
SCHEMBL22130016 0.85 CYP2A6 (0.56) ALDH1A1SMN1; SMN2MAPTTP53HPGD
SCHEMBL9975322 0.84 SMN1; SMN2 (0.67) KMT2AALDH1A1SMN1; SMN2MAPTTP53
SCHEMBL29543568 0.84 SMN1; SMN2 (0.73) KMT2AALDH1A1SMN1; SMN2MAPTTP53

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024039056-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2024-02-22 WO disclosed
US-11873294-B2 Compound containing anthrone and nitrogen-containing heterocycle and application in OLED devices JIANGSU SUNERA TECHNOLOGY CO., LTD. (CN) 2024-01-16 US disclosed
US-11873294-B2 Compound containing anthrone and nitrogen-containing heterocycle and application in OLED devices JIANGSU SUNERA TECHNOLOGY CO., LTD. (CN) 2024-01-16 US disclosed
WO-2021049843-A1 COMPOUND AND ORGANIC LIGHT EMITTING DEVICE COMPRISING SAME 주식회사 엘지화학 2021-03-18 WO disclosed
US-20210036245-A1 HETEROAROMATIC COMPOUNDS MERCK PATENT GMBH (DE) 2021-02-04 US disclosed
US-20200354347-A1 Compound containing anthrone and nitrogen-containing heterocycle and application in OLED devices VALIANT CO., LTD. (CN) 2020-11-12 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20200354347-A1 Compound containing anthrone and nitrogen-containing heterocycle and application in OLED devices NLRP1, OCIAD2, OCIAD1 KMT2A 3936/4885ALDH1A1 3143/4885SMN1; SMN2 3819/4885
US-20210036245-A1 HETEROAROMATIC COMPOUNDS ETV6, FES, LEF1 KMT2A 2115/4885ALDH1A1 752/4885SMN1; SMN2 3681/4885
US-11873294-B2 Compound containing anthrone and nitrogen-containing heterocycle and application in OLED devices NLRP1, OCIAD2, OCIAD1 KMT2A 3936/4885ALDH1A1 3143/4885SMN1; SMN2 3819/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.